Horsfiline; (ξ)-form, Demethoxy
AlkaPlorer ID: AK300659
Synonym: Coerulescine
IUPAC Name: 1'-methylspiro[1H-indole-3,3'-pyrrolidine]-2-one
Structure
SMILES: CN1CCC2(C1)C(O)=NC1=CC=CC=C12
InChI: InChI=1S/C12H14N2O/c1-14-7-6-12(8-14)9-4-2-3-5-10(9)13-11(12)15/h2-5H,6-8H2,1H3,(H,13,15)
InChIKey: PNYGHERLKSFRMH-UHFFFAOYSA-N
Reference
Oxindoles from Phalaris coerulescens
PubChem CID: 10932530
CAS: 211305-81-6
LOTUS: LTS0170957
COCONUT: CNP0114607.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phalaris coerulescens | Phalaris | Poaceae | Poales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 202.257
TPSA？: 35.83
MolLogP？: 1.8615000000000004
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mus musculus | Mus musculus | LD50 | nan | None | 10.1021/jm00229a007 |
| Rattus norvegicus | Rattus norvegicus | Activity | nan | None | 10.1021/jm00229a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 0.1 | hr | 10.1021/jm00229a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 0.1833 | hr | 10.1021/jm00229a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 0.9333 | hr | 10.1021/jm00229a007 |
| Rattus norvegicus | Rattus norvegicus | TIME | 1.383 | hr | 10.1021/jm00229a007 |